1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane

C11H22O5 — CID 5083600

IUPAC1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane
SMILESC=COCCOCCOCCOCCOC
InChIInChI=1S/C11H22O5/c1-3-13-6-7-15-10-11-16-9-8-14-5-4-12-2/h3H,1,4-11H2,2H3
InChIKeyJRQQTJXEDHVZRQ-UHFFFAOYSA-N
MW234.29 g/mol
LogP0.84
Rot. Bonds13

About 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane

1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane (PubChem CID 5083600) has the molecular formula C11H22O5 and a molecular weight of 234.29 g/mol. Its IUPAC name is 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane.

Molecular Properties

Compound Name1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane
PubChem CID5083600
Molecular FormulaC11H22O5
Molecular Weight234.29 g/mol
Exact Mass234.15
IUPAC Name1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane
SMILESC=COCCOCCOCCOCCOC
InChIInChI=1S/C11H22O5/c1-3-13-6-7-15-10-11-16-9-8-14-5-4-12-2/h3H,1,4-11H2,2H3
InChIKeyJRQQTJXEDHVZRQ-UHFFFAOYSA-N
XLogP0.84
TPSA46.15 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.29
LogP ≤ 50.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane?
The IUPAC name of 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane (CID 5083600) is 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane.
What is the SMILES notation for 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane?
The canonical SMILES for 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane is C=COCCOCCOCCOCCOC.
What is the InChIKey of 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane?
The InChIKey is JRQQTJXEDHVZRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O5/c1-3-13-6-7-15-10-11-16-9-8-14-5-4-12-2/h3H,1,4-11H2,2H3.
What are the key properties of 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane?
1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane has a molecular weight of 234.29 g/mol, XLogP of 0.84, 13 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-(2-ethenoxyethoxy)ethoxy]ethoxy]-2-methoxyethane is sourced from PubChem (CID 5083600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).